di-tert-butyl (tetrazolo[5,1-a]phthalazin-6-yl)propanedioate
Chemical Structure Depiction of
di-tert-butyl (tetrazolo[5,1-a]phthalazin-6-yl)propanedioate
di-tert-butyl (tetrazolo[5,1-a]phthalazin-6-yl)propanedioate
Compound characteristics
| Compound ID: | 8013-2094 |
| Compound Name: | di-tert-butyl (tetrazolo[5,1-a]phthalazin-6-yl)propanedioate |
| Molecular Weight: | 385.42 |
| Molecular Formula: | C19 H23 N5 O4 |
| Smiles: | CC(C)(C)OC(C(C(=O)OC(C)(C)C)c1c2ccccc2c2nnnn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9787 |
| logD: | 3.9787 |
| logSw: | -4.151 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 87.436 |
| InChI Key: | UBADANPFIJBYAP-UHFFFAOYSA-N |